USER MOD reduce.3.24.130724 H: found=0, std=0, add=547, rem=0, adj=15 USER MOD reduce.3.24.130724 removed 547 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 60 ASN : amide:sc= 0.373 K(o=0.89,f=-0.92) USER MOD Set 1.2: A 62 GLN : amide:sc= 0.52 K(o=0.89,f=-0.47) USER MOD Single : A 1 MET CE :methyl -177:sc= 0 (180deg=-0.018) USER MOD Single : A 1 MET N :NH3+ 177:sc= 0.821 (180deg=0.671) USER MOD Single : A 2 GLN : amide:sc= 1.16 K(o=1.2,f=-0.59) USER MOD Single : A 6 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 11 LYS NZ :NH3+ -120:sc= 0.898 (180deg=-0.259!) USER MOD Single : A 12 THR OG1 : rot 180:sc= 0 USER MOD Single : A 14 THR OG1 : rot -80:sc= 0.0294 USER MOD Single : A 20 SER OG : rot 180:sc= 0.0112 USER MOD Single : A 22 THR OG1 : rot 180:sc= 0.0119 USER MOD Single : A 25 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 27 LYS NZ :NH3+ -147:sc= 1.12 (180deg=0.453) USER MOD Single : A 29 LYS NZ :NH3+ 143:sc= 1.17 (180deg=0.321) USER MOD Single : A 31 GLN : amide:sc= -0.722 K(o=-0.72,f=-1.3) USER MOD Single : A 33 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 40 GLN : amide:sc= 0 X(o=0,f=-0.45) USER MOD Single : A 41 GLN : amide:sc= 1.45 K(o=1.4,f=-2.5!) USER MOD Single : A 48 LYS NZ :NH3+ -170:sc= 1.17 (180deg=1.08) USER MOD Single : A 49 GLN : amide:sc= 0.104 K(o=0.1,f=-1.2) USER MOD Single : A 55 THR OG1 : rot -69:sc= 1.31 USER MOD Single : A 57 SER OG : rot 180:sc= 0 USER MOD Single : A 59 TYR OH : rot 30:sc= 0.315 USER MOD Single : A 63 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 65 SER OG : rot 83:sc= 1.23 USER MOD Single : A 66 THR OG1 : rot 180:sc= 0 USER MOD Single : A 68 HIS : no HD1:sc= -0.0794 X(o=-0.079,f=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 32.665 52.221 19.923 1.00 0.00 N ATOM 2 CA MET A 1 32.952 52.522 21.334 1.00 0.00 C ATOM 3 C MET A 1 34.467 52.667 21.507 1.00 0.00 C ATOM 4 O MET A 1 35.201 52.005 20.777 1.00 0.00 O ATOM 5 CB MET A 1 32.393 51.468 22.284 1.00 0.00 C ATOM 6 CG MET A 1 33.004 50.080 22.111 1.00 0.00 C ATOM 7 SD MET A 1 32.335 48.826 23.233 1.00 0.00 S ATOM 8 CE MET A 1 33.377 47.422 22.769 1.00 0.00 C ATOM 0 H1 MET A 1 31.643 52.070 19.801 1.00 0.00 H new ATOM 0 H2 MET A 1 32.970 53.018 19.329 1.00 0.00 H new ATOM 0 H3 MET A 1 33.178 51.362 19.640 1.00 0.00 H new ATOM 0 HA MET A 1 32.454 53.456 21.594 1.00 0.00 H new ATOM 0 HB2 MET A 1 32.555 51.798 23.310 1.00 0.00 H new ATOM 0 HB3 MET A 1 31.315 51.399 22.138 1.00 0.00 H new ATOM 0 HG2 MET A 1 32.847 49.752 21.083 1.00 0.00 H new ATOM 0 HG3 MET A 1 34.081 50.149 22.262 1.00 0.00 H new ATOM 0 HE1 MET A 1 33.067 46.539 23.327 1.00 0.00 H new ATOM 0 HE2 MET A 1 33.275 47.231 21.701 1.00 0.00 H new ATOM 0 HE3 MET A 1 34.418 47.650 22.999 1.00 0.00 H new ATOM 20 N GLN A 2 34.938 53.479 22.449 1.00 0.00 N ATOM 21 CA GLN A 2 36.360 53.633 22.676 1.00 0.00 C ATOM 22 C GLN A 2 36.893 52.687 23.753 1.00 0.00 C ATOM 23 O GLN A 2 36.213 52.420 24.742 1.00 0.00 O ATOM 24 CB GLN A 2 36.756 55.089 22.904 1.00 0.00 C ATOM 25 CG GLN A 2 36.308 55.711 24.223 1.00 0.00 C ATOM 26 CD GLN A 2 36.778 57.159 24.384 1.00 0.00 C ATOM 27 OE1 GLN A 2 37.391 57.762 23.506 1.00 0.00 O ATOM 28 NE2 GLN A 2 36.509 57.785 25.526 1.00 0.00 N ATOM 0 H GLN A 2 34.349 54.039 23.066 1.00 0.00 H new ATOM 0 HA GLN A 2 36.855 53.330 21.753 1.00 0.00 H new ATOM 0 HB2 GLN A 2 37.842 55.162 22.842 1.00 0.00 H new ATOM 0 HB3 GLN A 2 36.349 55.686 22.088 1.00 0.00 H new ATOM 0 HG2 GLN A 2 35.220 55.678 24.285 1.00 0.00 H new ATOM 0 HG3 GLN A 2 36.693 55.115 25.050 1.00 0.00 H new ATOM 0 HE21 GLN A 2 36.001 57.300 26.266 1.00 0.00 H new ATOM 0 HE22 GLN A 2 36.810 58.750 25.662 1.00 0.00 H new ATOM 37 N ILE A 3 38.127 52.228 23.567 1.00 0.00 N ATOM 38 CA ILE A 3 38.936 51.548 24.557 1.00 0.00 C ATOM 39 C ILE A 3 40.322 52.193 24.622 1.00 0.00 C ATOM 40 O ILE A 3 40.707 52.943 23.727 1.00 0.00 O ATOM 41 CB ILE A 3 38.986 50.041 24.323 1.00 0.00 C ATOM 42 CG1 ILE A 3 39.585 49.576 22.999 1.00 0.00 C ATOM 43 CG2 ILE A 3 37.588 49.445 24.467 1.00 0.00 C ATOM 44 CD1 ILE A 3 41.110 49.582 22.931 1.00 0.00 C ATOM 0 H ILE A 3 38.609 52.329 22.674 1.00 0.00 H new ATOM 0 HA ILE A 3 38.469 51.667 25.535 1.00 0.00 H new ATOM 0 HB ILE A 3 39.673 49.680 25.089 1.00 0.00 H new ATOM 0 HG12 ILE A 3 39.233 48.564 22.796 1.00 0.00 H new ATOM 0 HG13 ILE A 3 39.200 50.213 22.202 1.00 0.00 H new ATOM 0 HG21 ILE A 3 37.632 48.369 24.299 1.00 0.00 H new ATOM 0 HG22 ILE A 3 37.211 49.640 25.471 1.00 0.00 H new ATOM 0 HG23 ILE A 3 36.921 49.900 23.734 1.00 0.00 H new ATOM 0 HD11 ILE A 3 41.432 49.235 21.949 1.00 0.00 H new ATOM 0 HD12 ILE A 3 41.478 50.595 23.096 1.00 0.00 H new ATOM 0 HD13 ILE A 3 41.511 48.921 23.699 1.00 0.00 H new ATOM 56 N PHE A 4 41.087 51.876 25.662 1.00 0.00 N ATOM 57 CA PHE A 4 42.415 52.411 25.885 1.00 0.00 C ATOM 58 C PHE A 4 43.449 51.292 26.018 1.00 0.00 C ATOM 59 O PHE A 4 43.136 50.217 26.525 1.00 0.00 O ATOM 60 CB PHE A 4 42.416 53.309 27.119 1.00 0.00 C ATOM 61 CG PHE A 4 41.301 54.326 27.164 1.00 0.00 C ATOM 62 CD1 PHE A 4 41.285 55.395 26.260 1.00 0.00 C ATOM 63 CD2 PHE A 4 40.279 54.203 28.112 1.00 0.00 C ATOM 64 CE1 PHE A 4 40.252 56.338 26.311 1.00 0.00 C ATOM 65 CE2 PHE A 4 39.252 55.152 28.171 1.00 0.00 C ATOM 66 CZ PHE A 4 39.235 56.220 27.267 1.00 0.00 C ATOM 0 H PHE A 4 40.788 51.224 26.387 1.00 0.00 H new ATOM 0 HA PHE A 4 42.695 53.010 25.018 1.00 0.00 H new ATOM 0 HB2 PHE A 4 42.352 52.681 28.008 1.00 0.00 H new ATOM 0 HB3 PHE A 4 43.370 53.834 27.168 1.00 0.00 H new ATOM 0 HD1 PHE A 4 42.069 55.492 25.524 1.00 0.00 H new ATOM 0 HD2 PHE A 4 40.283 53.372 28.801 1.00 0.00 H new ATOM 0 HE1 PHE A 4 40.239 57.160 25.610 1.00 0.00 H new ATOM 0 HE2 PHE A 4 38.473 55.060 28.914 1.00 0.00 H new ATOM 0 HZ PHE A 4 38.441 56.951 27.306 1.00 0.00 H new ATOM 76 N VAL A 5 44.686 51.539 25.597 1.00 0.00 N ATOM 77 CA VAL A 5 45.789 50.611 25.744 1.00 0.00 C ATOM 78 C VAL A 5 46.984 51.316 26.386 1.00 0.00 C ATOM 79 O VAL A 5 47.347 52.406 25.948 1.00 0.00 O ATOM 80 CB VAL A 5 46.155 49.943 24.421 1.00 0.00 C ATOM 81 CG1 VAL A 5 47.185 48.838 24.638 1.00 0.00 C ATOM 82 CG2 VAL A 5 44.951 49.320 23.721 1.00 0.00 C ATOM 0 H VAL A 5 44.949 52.410 25.135 1.00 0.00 H new ATOM 0 HA VAL A 5 45.474 49.806 26.408 1.00 0.00 H new ATOM 0 HB VAL A 5 46.559 50.737 23.793 1.00 0.00 H new ATOM 0 HG11 VAL A 5 47.430 48.376 23.682 1.00 0.00 H new ATOM 0 HG12 VAL A 5 48.087 49.263 25.078 1.00 0.00 H new ATOM 0 HG13 VAL A 5 46.774 48.084 25.310 1.00 0.00 H new ATOM 0 HG21 VAL A 5 45.271 48.860 22.786 1.00 0.00 H new ATOM 0 HG22 VAL A 5 44.508 48.561 24.366 1.00 0.00 H new ATOM 0 HG23 VAL A 5 44.212 50.093 23.510 1.00 0.00 H new ATOM 92 N LYS A 6 47.574 50.713 27.415 1.00 0.00 N ATOM 93 CA LYS A 6 48.602 51.263 28.275 1.00 0.00 C ATOM 94 C LYS A 6 49.873 50.410 28.273 1.00 0.00 C ATOM 95 O LYS A 6 49.774 49.188 28.343 1.00 0.00 O ATOM 96 CB LYS A 6 48.007 51.372 29.675 1.00 0.00 C ATOM 97 CG LYS A 6 48.978 51.898 30.729 1.00 0.00 C ATOM 98 CD LYS A 6 48.320 51.965 32.104 1.00 0.00 C ATOM 99 CE LYS A 6 49.349 52.252 33.195 1.00 0.00 C ATOM 100 NZ LYS A 6 49.788 53.655 33.207 1.00 0.00 N ATOM 0 H LYS A 6 47.324 49.761 27.683 1.00 0.00 H new ATOM 0 HA LYS A 6 48.907 52.243 27.909 1.00 0.00 H new ATOM 0 HB2 LYS A 6 47.138 52.029 29.638 1.00 0.00 H new ATOM 0 HB3 LYS A 6 47.651 50.389 29.984 1.00 0.00 H new ATOM 0 HG2 LYS A 6 49.855 51.252 30.774 1.00 0.00 H new ATOM 0 HG3 LYS A 6 49.328 52.890 30.442 1.00 0.00 H new ATOM 0 HD2 LYS A 6 47.556 52.743 32.107 1.00 0.00 H new ATOM 0 HD3 LYS A 6 47.816 51.022 32.315 1.00 0.00 H new ATOM 0 HE2 LYS A 6 48.922 52.001 34.166 1.00 0.00 H new ATOM 0 HE3 LYS A 6 50.215 51.606 33.051 1.00 0.00 H new ATOM 0 HZ1 LYS A 6 50.485 53.794 33.966 1.00 0.00 H new ATOM 0 HZ2 LYS A 6 50.221 53.891 32.291 1.00 0.00 H new ATOM 0 HZ3 LYS A 6 48.969 54.274 33.372 1.00 0.00 H new ATOM 168 N LYS A 11 53.280 54.979 27.675 1.00 0.00 N ATOM 169 CA LYS A 11 52.463 55.353 26.538 1.00 0.00 C ATOM 170 C LYS A 11 51.028 54.887 26.790 1.00 0.00 C ATOM 171 O LYS A 11 50.819 53.745 27.194 1.00 0.00 O ATOM 172 CB LYS A 11 53.067 54.784 25.258 1.00 0.00 C ATOM 173 CG LYS A 11 52.306 55.065 23.966 1.00 0.00 C ATOM 174 CD LYS A 11 52.125 56.535 23.596 1.00 0.00 C ATOM 175 CE LYS A 11 53.427 57.256 23.259 1.00 0.00 C ATOM 176 NZ LYS A 11 53.773 57.157 21.833 1.00 0.00 N ATOM 0 HA LYS A 11 52.438 56.435 26.411 1.00 0.00 H new ATOM 0 HB2 LYS A 11 54.077 55.179 25.152 1.00 0.00 H new ATOM 0 HB3 LYS A 11 53.157 53.704 25.373 1.00 0.00 H new ATOM 0 HG2 LYS A 11 52.826 54.567 23.147 1.00 0.00 H new ATOM 0 HG3 LYS A 11 51.320 54.607 24.043 1.00 0.00 H new ATOM 0 HD2 LYS A 11 51.452 56.604 22.741 1.00 0.00 H new ATOM 0 HD3 LYS A 11 51.640 57.051 24.425 1.00 0.00 H new ATOM 0 HE2 LYS A 11 53.339 58.307 23.536 1.00 0.00 H new ATOM 0 HE3 LYS A 11 54.236 56.836 23.856 1.00 0.00 H new ATOM 0 HZ1 LYS A 11 54.694 56.685 21.731 1.00 0.00 H new ATOM 0 HZ2 LYS A 11 53.045 56.605 21.337 1.00 0.00 H new ATOM 0 HZ3 LYS A 11 53.825 58.111 21.421 1.00 0.00 H new ATOM 190 N THR A 12 50.050 55.747 26.517 1.00 0.00 N ATOM 191 CA THR A 12 48.640 55.413 26.494 1.00 0.00 C ATOM 192 C THR A 12 48.047 55.818 25.144 1.00 0.00 C ATOM 193 O THR A 12 48.342 56.905 24.650 1.00 0.00 O ATOM 194 CB THR A 12 47.861 56.069 27.630 1.00 0.00 C ATOM 195 OG1 THR A 12 48.532 55.956 28.865 1.00 0.00 O ATOM 196 CG2 THR A 12 46.491 55.425 27.826 1.00 0.00 C ATOM 0 H THR A 12 50.230 56.727 26.299 1.00 0.00 H new ATOM 0 HA THR A 12 48.553 54.336 26.636 1.00 0.00 H new ATOM 0 HB THR A 12 47.761 57.115 27.339 1.00 0.00 H new ATOM 0 HG1 THR A 12 48.002 56.390 29.566 1.00 0.00 H new ATOM 0 HG21 THR A 12 45.969 55.922 28.644 1.00 0.00 H new ATOM 0 HG22 THR A 12 45.908 55.524 26.910 1.00 0.00 H new ATOM 0 HG23 THR A 12 46.616 54.369 28.064 1.00 0.00 H new ATOM 204 N ILE A 13 47.224 54.967 24.538 1.00 0.00 N ATOM 205 CA ILE A 13 46.577 55.202 23.263 1.00 0.00 C ATOM 206 C ILE A 13 45.083 54.877 23.319 1.00 0.00 C ATOM 207 O ILE A 13 44.683 53.976 24.052 1.00 0.00 O ATOM 208 CB ILE A 13 47.268 54.449 22.129 1.00 0.00 C ATOM 209 CG1 ILE A 13 47.283 52.938 22.338 1.00 0.00 C ATOM 210 CG2 ILE A 13 48.684 54.981 21.930 1.00 0.00 C ATOM 211 CD1 ILE A 13 47.908 52.128 21.206 1.00 0.00 C ATOM 0 H ILE A 13 46.984 54.062 24.942 1.00 0.00 H new ATOM 0 HA ILE A 13 46.672 56.267 23.050 1.00 0.00 H new ATOM 0 HB ILE A 13 46.684 54.628 21.226 1.00 0.00 H new ATOM 0 HG12 ILE A 13 47.824 52.721 23.259 1.00 0.00 H new ATOM 0 HG13 ILE A 13 46.258 52.598 22.483 1.00 0.00 H new ATOM 0 HG21 ILE A 13 49.167 54.436 21.119 1.00 0.00 H new ATOM 0 HG22 ILE A 13 48.643 56.041 21.681 1.00 0.00 H new ATOM 0 HG23 ILE A 13 49.256 54.846 22.848 1.00 0.00 H new ATOM 0 HD11 ILE A 13 47.869 51.067 21.453 1.00 0.00 H new ATOM 0 HD12 ILE A 13 47.356 52.306 20.283 1.00 0.00 H new ATOM 0 HD13 ILE A 13 48.946 52.431 21.072 1.00 0.00 H new ATOM 223 N THR A 14 44.274 55.574 22.526 1.00 0.00 N ATOM 224 CA THR A 14 42.857 55.311 22.368 1.00 0.00 C ATOM 225 C THR A 14 42.582 54.614 21.034 1.00 0.00 C ATOM 226 O THR A 14 43.178 54.987 20.025 1.00 0.00 O ATOM 227 CB THR A 14 42.028 56.591 22.421 1.00 0.00 C ATOM 228 OG1 THR A 14 42.392 57.417 23.504 1.00 0.00 O ATOM 229 CG2 THR A 14 40.536 56.309 22.573 1.00 0.00 C ATOM 0 H THR A 14 44.601 56.358 21.962 1.00 0.00 H new ATOM 0 HA THR A 14 42.567 54.667 23.198 1.00 0.00 H new ATOM 0 HB THR A 14 42.229 57.089 21.473 1.00 0.00 H new ATOM 0 HG1 THR A 14 41.976 57.082 24.325 1.00 0.00 H new ATOM 0 HG21 THR A 14 39.989 57.251 22.606 1.00 0.00 H new ATOM 0 HG22 THR A 14 40.189 55.718 21.726 1.00 0.00 H new ATOM 0 HG23 THR A 14 40.362 55.756 23.496 1.00 0.00 H new ATOM 237 N LEU A 15 41.674 53.643 21.013 1.00 0.00 N ATOM 238 CA LEU A 15 41.156 53.040 19.802 1.00 0.00 C ATOM 239 C LEU A 15 39.627 52.994 19.806 1.00 0.00 C ATOM 240 O LEU A 15 39.016 52.826 20.859 1.00 0.00 O ATOM 241 CB LEU A 15 41.757 51.656 19.565 1.00 0.00 C ATOM 242 CG LEU A 15 43.272 51.637 19.383 1.00 0.00 C ATOM 243 CD1 LEU A 15 44.016 51.336 20.680 1.00 0.00 C ATOM 244 CD2 LEU A 15 43.702 50.567 18.385 1.00 0.00 C ATOM 0 H LEU A 15 41.271 53.248 21.863 1.00 0.00 H new ATOM 0 HA LEU A 15 41.459 53.674 18.969 1.00 0.00 H new ATOM 0 HB2 LEU A 15 41.499 51.014 20.407 1.00 0.00 H new ATOM 0 HB3 LEU A 15 41.294 51.221 18.679 1.00 0.00 H new ATOM 0 HG LEU A 15 43.523 52.636 19.028 1.00 0.00 H new ATOM 0 HD11 LEU A 15 45.090 51.335 20.492 1.00 0.00 H new ATOM 0 HD12 LEU A 15 43.778 52.099 21.421 1.00 0.00 H new ATOM 0 HD13 LEU A 15 43.713 50.359 21.055 1.00 0.00 H new ATOM 0 HD21 LEU A 15 44.787 50.582 18.280 1.00 0.00 H new ATOM 0 HD22 LEU A 15 43.386 49.587 18.743 1.00 0.00 H new ATOM 0 HD23 LEU A 15 43.241 50.766 17.417 1.00 0.00 H new ATOM 256 N GLU A 16 39.019 53.104 18.628 1.00 0.00 N ATOM 257 CA GLU A 16 37.590 52.993 18.414 1.00 0.00 C ATOM 258 C GLU A 16 37.273 51.642 17.770 1.00 0.00 C ATOM 259 O GLU A 16 37.845 51.289 16.741 1.00 0.00 O ATOM 260 CB GLU A 16 37.075 54.177 17.603 1.00 0.00 C ATOM 261 CG GLU A 16 36.092 55.064 18.361 1.00 0.00 C ATOM 262 CD GLU A 16 34.727 54.441 18.659 1.00 0.00 C ATOM 263 OE1 GLU A 16 34.301 53.465 18.004 1.00 0.00 O ATOM 264 OE2 GLU A 16 34.025 54.935 19.567 1.00 0.00 O ATOM 0 H GLU A 16 39.534 53.280 17.766 1.00 0.00 H new ATOM 0 HA GLU A 16 37.067 53.029 19.369 1.00 0.00 H new ATOM 0 HB2 GLU A 16 37.923 54.782 17.283 1.00 0.00 H new ATOM 0 HB3 GLU A 16 36.591 53.804 16.700 1.00 0.00 H new ATOM 0 HG2 GLU A 16 36.550 55.358 19.305 1.00 0.00 H new ATOM 0 HG3 GLU A 16 35.936 55.976 17.785 1.00 0.00 H new ATOM 271 N VAL A 17 36.405 50.864 18.411 1.00 0.00 N ATOM 272 CA VAL A 17 36.206 49.447 18.185 1.00 0.00 C ATOM 273 C VAL A 17 34.732 49.045 18.258 1.00 0.00 C ATOM 274 O VAL A 17 33.897 49.764 18.803 1.00 0.00 O ATOM 275 CB VAL A 17 37.025 48.619 19.170 1.00 0.00 C ATOM 276 CG1 VAL A 17 38.529 48.810 18.987 1.00 0.00 C ATOM 277 CG2 VAL A 17 36.680 48.898 20.630 1.00 0.00 C ATOM 0 H VAL A 17 35.792 51.231 19.139 1.00 0.00 H new ATOM 0 HA VAL A 17 36.551 49.241 17.172 1.00 0.00 H new ATOM 0 HB VAL A 17 36.756 47.588 18.938 1.00 0.00 H new ATOM 0 HG11 VAL A 17 39.064 48.198 19.713 1.00 0.00 H new ATOM 0 HG12 VAL A 17 38.814 48.509 17.979 1.00 0.00 H new ATOM 0 HG13 VAL A 17 38.784 49.859 19.138 1.00 0.00 H new ATOM 0 HG21 VAL A 17 37.299 48.275 21.276 1.00 0.00 H new ATOM 0 HG22 VAL A 17 36.865 49.949 20.853 1.00 0.00 H new ATOM 0 HG23 VAL A 17 35.629 48.669 20.806 1.00 0.00 H new ATOM 287 N GLU A 18 34.408 47.872 17.720 1.00 0.00 N ATOM 288 CA GLU A 18 33.121 47.206 17.746 1.00 0.00 C ATOM 289 C GLU A 18 33.209 45.924 18.576 1.00 0.00 C ATOM 290 O GLU A 18 34.239 45.259 18.494 1.00 0.00 O ATOM 291 CB GLU A 18 32.721 46.922 16.302 1.00 0.00 C ATOM 292 CG GLU A 18 31.347 46.302 16.066 1.00 0.00 C ATOM 293 CD GLU A 18 31.085 46.202 14.562 1.00 0.00 C ATOM 294 OE1 GLU A 18 30.278 46.990 14.024 1.00 0.00 O ATOM 295 OE2 GLU A 18 31.765 45.409 13.873 1.00 0.00 O ATOM 0 H GLU A 18 35.102 47.322 17.214 1.00 0.00 H new ATOM 0 HA GLU A 18 32.363 47.833 18.215 1.00 0.00 H new ATOM 0 HB2 GLU A 18 32.768 47.860 15.748 1.00 0.00 H new ATOM 0 HB3 GLU A 18 33.469 46.259 15.869 1.00 0.00 H new ATOM 0 HG2 GLU A 18 31.300 45.313 16.521 1.00 0.00 H new ATOM 0 HG3 GLU A 18 30.576 46.909 16.541 1.00 0.00 H new ATOM 302 N PRO A 19 32.205 45.520 19.350 1.00 0.00 N ATOM 303 CA PRO A 19 32.312 44.367 20.221 1.00 0.00 C ATOM 304 C PRO A 19 32.715 43.058 19.539 1.00 0.00 C ATOM 305 O PRO A 19 33.413 42.241 20.136 1.00 0.00 O ATOM 306 CB PRO A 19 30.954 44.229 20.904 1.00 0.00 C ATOM 307 CG PRO A 19 30.426 45.660 20.918 1.00 0.00 C ATOM 308 CD PRO A 19 30.964 46.223 19.606 1.00 0.00 C ATOM 0 HA PRO A 19 33.129 44.542 20.921 1.00 0.00 H new ATOM 0 HB2 PRO A 19 30.292 43.561 20.353 1.00 0.00 H new ATOM 0 HB3 PRO A 19 31.049 43.825 21.912 1.00 0.00 H new ATOM 0 HG2 PRO A 19 29.337 45.690 20.957 1.00 0.00 H new ATOM 0 HG3 PRO A 19 30.791 46.219 21.780 1.00 0.00 H new ATOM 0 HD2 PRO A 19 30.253 46.068 18.794 1.00 0.00 H new ATOM 0 HD3 PRO A 19 31.132 47.297 19.682 1.00 0.00 H new ATOM 316 N SER A 20 32.323 42.860 18.284 1.00 0.00 N ATOM 317 CA SER A 20 32.692 41.709 17.486 1.00 0.00 C ATOM 318 C SER A 20 34.088 41.767 16.862 1.00 0.00 C ATOM 319 O SER A 20 34.479 40.794 16.220 1.00 0.00 O ATOM 320 CB SER A 20 31.623 41.447 16.428 1.00 0.00 C ATOM 321 OG SER A 20 31.348 42.603 15.670 1.00 0.00 O ATOM 0 H SER A 20 31.723 43.518 17.786 1.00 0.00 H new ATOM 0 HA SER A 20 32.746 40.872 18.182 1.00 0.00 H new ATOM 0 HB2 SER A 20 31.954 40.647 15.766 1.00 0.00 H new ATOM 0 HB3 SER A 20 30.709 41.102 16.911 1.00 0.00 H new ATOM 0 HG SER A 20 30.661 42.400 15.001 1.00 0.00 H new ATOM 327 N ASP A 21 34.859 42.839 17.023 1.00 0.00 N ATOM 328 CA ASP A 21 36.204 42.930 16.493 1.00 0.00 C ATOM 329 C ASP A 21 37.137 41.910 17.148 1.00 0.00 C ATOM 330 O ASP A 21 37.081 41.682 18.355 1.00 0.00 O ATOM 331 CB ASP A 21 36.773 44.338 16.640 1.00 0.00 C ATOM 332 CG ASP A 21 36.153 45.392 15.721 1.00 0.00 C ATOM 333 OD1 ASP A 21 35.599 45.056 14.653 1.00 0.00 O ATOM 334 OD2 ASP A 21 36.315 46.601 15.996 1.00 0.00 O ATOM 0 H ASP A 21 34.560 43.672 17.530 1.00 0.00 H new ATOM 0 HA ASP A 21 36.139 42.699 15.430 1.00 0.00 H new ATOM 0 HB2 ASP A 21 36.643 44.659 17.674 1.00 0.00 H new ATOM 0 HB3 ASP A 21 37.846 44.300 16.451 1.00 0.00 H new ATOM 339 N THR A 22 38.019 41.302 16.359 1.00 0.00 N ATOM 340 CA THR A 22 39.016 40.361 16.827 1.00 0.00 C ATOM 341 C THR A 22 40.272 41.046 17.372 1.00 0.00 C ATOM 342 O THR A 22 40.665 42.122 16.926 1.00 0.00 O ATOM 343 CB THR A 22 39.401 39.327 15.773 1.00 0.00 C ATOM 344 OG1 THR A 22 39.569 39.910 14.499 1.00 0.00 O ATOM 345 CG2 THR A 22 38.330 38.249 15.636 1.00 0.00 C ATOM 0 H THR A 22 38.056 41.459 15.352 1.00 0.00 H new ATOM 0 HA THR A 22 38.534 39.835 17.651 1.00 0.00 H new ATOM 0 HB THR A 22 40.342 38.894 16.113 1.00 0.00 H new ATOM 0 HG1 THR A 22 39.817 39.217 13.852 1.00 0.00 H new ATOM 0 HG21 THR A 22 38.634 37.528 14.877 1.00 0.00 H new ATOM 0 HG22 THR A 22 38.203 37.739 16.591 1.00 0.00 H new ATOM 0 HG23 THR A 22 37.387 38.709 15.342 1.00 0.00 H new ATOM 353 N ILE A 23 40.942 40.385 18.311 1.00 0.00 N ATOM 354 CA ILE A 23 42.146 40.884 18.943 1.00 0.00 C ATOM 355 C ILE A 23 43.242 41.153 17.911 1.00 0.00 C ATOM 356 O ILE A 23 43.914 42.176 18.022 1.00 0.00 O ATOM 357 CB ILE A 23 42.572 39.921 20.048 1.00 0.00 C ATOM 358 CG1 ILE A 23 41.612 39.912 21.235 1.00 0.00 C ATOM 359 CG2 ILE A 23 43.999 40.132 20.545 1.00 0.00 C ATOM 360 CD1 ILE A 23 41.478 41.213 22.020 1.00 0.00 C ATOM 0 H ILE A 23 40.653 39.470 18.657 1.00 0.00 H new ATOM 0 HA ILE A 23 41.947 41.849 19.410 1.00 0.00 H new ATOM 0 HB ILE A 23 42.537 38.945 19.563 1.00 0.00 H new ATOM 0 HG12 ILE A 23 40.624 39.632 20.871 1.00 0.00 H new ATOM 0 HG13 ILE A 23 41.931 39.130 21.924 1.00 0.00 H new ATOM 0 HG21 ILE A 23 44.222 39.408 21.329 1.00 0.00 H new ATOM 0 HG22 ILE A 23 44.696 39.998 19.718 1.00 0.00 H new ATOM 0 HG23 ILE A 23 44.100 41.141 20.944 1.00 0.00 H new ATOM 0 HD11 ILE A 23 40.768 41.075 22.835 1.00 0.00 H new ATOM 0 HD12 ILE A 23 42.449 41.493 22.428 1.00 0.00 H new ATOM 0 HD13 ILE A 23 41.121 42.002 21.358 1.00 0.00 H new ATOM 372 N GLU A 24 43.390 40.340 16.868 1.00 0.00 N ATOM 373 CA GLU A 24 44.353 40.582 15.813 1.00 0.00 C ATOM 374 C GLU A 24 44.072 41.819 14.958 1.00 0.00 C ATOM 375 O GLU A 24 45.006 42.475 14.501 1.00 0.00 O ATOM 376 CB GLU A 24 44.506 39.346 14.930 1.00 0.00 C ATOM 377 CG GLU A 24 43.260 38.988 14.127 1.00 0.00 C ATOM 378 CD GLU A 24 43.488 37.777 13.221 1.00 0.00 C ATOM 379 OE1 GLU A 24 44.471 37.771 12.448 1.00 0.00 O ATOM 380 OE2 GLU A 24 42.667 36.835 13.254 1.00 0.00 O ATOM 0 H GLU A 24 42.839 39.492 16.736 1.00 0.00 H new ATOM 0 HA GLU A 24 45.291 40.793 16.326 1.00 0.00 H new ATOM 0 HB2 GLU A 24 45.334 39.508 14.240 1.00 0.00 H new ATOM 0 HB3 GLU A 24 44.775 38.497 15.558 1.00 0.00 H new ATOM 0 HG2 GLU A 24 42.437 38.779 14.810 1.00 0.00 H new ATOM 0 HG3 GLU A 24 42.962 39.843 13.520 1.00 0.00 H new ATOM 387 N ASN A 25 42.806 42.178 14.761 1.00 0.00 N ATOM 388 CA ASN A 25 42.419 43.387 14.063 1.00 0.00 C ATOM 389 C ASN A 25 42.783 44.620 14.892 1.00 0.00 C ATOM 390 O ASN A 25 43.397 45.557 14.386 1.00 0.00 O ATOM 391 CB ASN A 25 40.930 43.308 13.739 1.00 0.00 C ATOM 392 CG ASN A 25 40.366 44.609 13.165 1.00 0.00 C ATOM 393 OD1 ASN A 25 39.689 45.376 13.845 1.00 0.00 O ATOM 394 ND2 ASN A 25 40.605 44.884 11.886 1.00 0.00 N ATOM 0 H ASN A 25 42.014 41.625 15.089 1.00 0.00 H new ATOM 0 HA ASN A 25 42.964 43.480 13.124 1.00 0.00 H new ATOM 0 HB2 ASN A 25 40.763 42.501 13.025 1.00 0.00 H new ATOM 0 HB3 ASN A 25 40.381 43.051 14.645 1.00 0.00 H new ATOM 0 HD21 ASN A 25 40.226 45.733 11.468 1.00 0.00 H new ATOM 0 HD22 ASN A 25 41.167 44.246 11.324 1.00 0.00 H new ATOM 401 N VAL A 26 42.516 44.578 16.195 1.00 0.00 N ATOM 402 CA VAL A 26 42.869 45.650 17.103 1.00 0.00 C ATOM 403 C VAL A 26 44.385 45.761 17.281 1.00 0.00 C ATOM 404 O VAL A 26 44.889 46.882 17.278 1.00 0.00 O ATOM 405 CB VAL A 26 42.091 45.516 18.410 1.00 0.00 C ATOM 406 CG1 VAL A 26 42.431 46.608 19.420 1.00 0.00 C ATOM 407 CG2 VAL A 26 40.588 45.600 18.156 1.00 0.00 C ATOM 0 H VAL A 26 42.046 43.793 16.646 1.00 0.00 H new ATOM 0 HA VAL A 26 42.569 46.603 16.667 1.00 0.00 H new ATOM 0 HB VAL A 26 42.376 44.546 18.817 1.00 0.00 H new ATOM 0 HG11 VAL A 26 41.846 46.459 20.328 1.00 0.00 H new ATOM 0 HG12 VAL A 26 43.493 46.563 19.661 1.00 0.00 H new ATOM 0 HG13 VAL A 26 42.197 47.583 18.994 1.00 0.00 H new ATOM 0 HG21 VAL A 26 40.053 45.502 19.101 1.00 0.00 H new ATOM 0 HG22 VAL A 26 40.349 46.562 17.702 1.00 0.00 H new ATOM 0 HG23 VAL A 26 40.287 44.796 17.484 1.00 0.00 H new ATOM 417 N LYS A 27 45.152 44.674 17.289 1.00 0.00 N ATOM 418 CA LYS A 27 46.600 44.702 17.278 1.00 0.00 C ATOM 419 C LYS A 27 47.170 45.370 16.025 1.00 0.00 C ATOM 420 O LYS A 27 48.124 46.141 16.120 1.00 0.00 O ATOM 421 CB LYS A 27 47.182 43.297 17.411 1.00 0.00 C ATOM 422 CG LYS A 27 47.032 42.694 18.804 1.00 0.00 C ATOM 423 CD LYS A 27 47.433 41.223 18.850 1.00 0.00 C ATOM 424 CE LYS A 27 48.936 41.035 19.042 1.00 0.00 C ATOM 425 NZ LYS A 27 49.344 39.656 18.738 1.00 0.00 N ATOM 0 H LYS A 27 44.768 43.729 17.304 1.00 0.00 H new ATOM 0 HA LYS A 27 46.893 45.301 18.140 1.00 0.00 H new ATOM 0 HB2 LYS A 27 46.694 42.643 16.688 1.00 0.00 H new ATOM 0 HB3 LYS A 27 48.240 43.327 17.151 1.00 0.00 H new ATOM 0 HG2 LYS A 27 47.645 43.257 19.508 1.00 0.00 H new ATOM 0 HG3 LYS A 27 45.997 42.796 19.131 1.00 0.00 H new ATOM 0 HD2 LYS A 27 46.901 40.730 19.663 1.00 0.00 H new ATOM 0 HD3 LYS A 27 47.124 40.736 17.925 1.00 0.00 H new ATOM 0 HE2 LYS A 27 49.477 41.727 18.397 1.00 0.00 H new ATOM 0 HE3 LYS A 27 49.207 41.279 20.069 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 50.138 39.385 19.353 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 48.543 39.013 18.903 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 49.640 39.593 17.743 1.00 0.00 H new ATOM 439 N ALA A 28 46.588 45.132 14.854 1.00 0.00 N ATOM 440 CA ALA A 28 46.981 45.813 13.635 1.00 0.00 C ATOM 441 C ALA A 28 46.620 47.299 13.628 1.00 0.00 C ATOM 442 O ALA A 28 47.306 48.086 12.980 1.00 0.00 O ATOM 443 CB ALA A 28 46.384 45.072 12.442 1.00 0.00 C ATOM 0 H ALA A 28 45.831 44.460 14.728 1.00 0.00 H new ATOM 0 HA ALA A 28 48.069 45.793 13.570 1.00 0.00 H new ATOM 0 HB1 ALA A 28 46.673 45.575 11.519 1.00 0.00 H new ATOM 0 HB2 ALA A 28 46.755 44.047 12.428 1.00 0.00 H new ATOM 0 HB3 ALA A 28 45.297 45.064 12.526 1.00 0.00 H new ATOM 449 N LYS A 29 45.607 47.720 14.382 1.00 0.00 N ATOM 450 CA LYS A 29 45.311 49.121 14.606 1.00 0.00 C ATOM 451 C LYS A 29 46.264 49.757 15.621 1.00 0.00 C ATOM 452 O LYS A 29 46.695 50.890 15.419 1.00 0.00 O ATOM 453 CB LYS A 29 43.839 49.301 14.964 1.00 0.00 C ATOM 454 CG LYS A 29 42.941 49.007 13.764 1.00 0.00 C ATOM 455 CD LYS A 29 41.452 48.969 14.094 1.00 0.00 C ATOM 456 CE LYS A 29 40.913 50.267 14.689 1.00 0.00 C ATOM 457 NZ LYS A 29 39.444 50.242 14.746 1.00 0.00 N ATOM 0 H LYS A 29 44.965 47.086 14.857 1.00 0.00 H new ATOM 0 HA LYS A 29 45.484 49.663 13.676 1.00 0.00 H new ATOM 0 HB2 LYS A 29 43.578 48.637 15.788 1.00 0.00 H new ATOM 0 HB3 LYS A 29 43.668 50.321 15.309 1.00 0.00 H new ATOM 0 HG2 LYS A 29 43.114 49.765 13.000 1.00 0.00 H new ATOM 0 HG3 LYS A 29 43.231 48.049 13.333 1.00 0.00 H new ATOM 0 HD2 LYS A 29 40.895 48.739 13.186 1.00 0.00 H new ATOM 0 HD3 LYS A 29 41.267 48.156 14.796 1.00 0.00 H new ATOM 0 HE2 LYS A 29 41.318 50.410 15.691 1.00 0.00 H new ATOM 0 HE3 LYS A 29 41.244 51.114 14.088 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 39.122 50.716 15.614 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 39.056 50.736 13.917 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 39.113 49.256 14.747 1.00 0.00 H new ATOM 471 N ILE A 30 46.714 49.021 16.634 1.00 0.00 N ATOM 472 CA ILE A 30 47.785 49.425 17.522 1.00 0.00 C ATOM 473 C ILE A 30 49.085 49.639 16.744 1.00 0.00 C ATOM 474 O ILE A 30 49.820 50.579 17.039 1.00 0.00 O ATOM 475 CB ILE A 30 47.933 48.450 18.687 1.00 0.00 C ATOM 476 CG1 ILE A 30 46.708 48.496 19.597 1.00 0.00 C ATOM 477 CG2 ILE A 30 49.195 48.712 19.503 1.00 0.00 C ATOM 478 CD1 ILE A 30 46.615 47.336 20.584 1.00 0.00 C ATOM 0 H ILE A 30 46.329 48.104 16.860 1.00 0.00 H new ATOM 0 HA ILE A 30 47.528 50.387 17.965 1.00 0.00 H new ATOM 0 HB ILE A 30 48.018 47.454 18.252 1.00 0.00 H new ATOM 0 HG12 ILE A 30 46.719 49.432 20.155 1.00 0.00 H new ATOM 0 HG13 ILE A 30 45.811 48.504 18.978 1.00 0.00 H new ATOM 0 HG21 ILE A 30 49.256 47.993 20.320 1.00 0.00 H new ATOM 0 HG22 ILE A 30 50.071 48.608 18.862 1.00 0.00 H new ATOM 0 HG23 ILE A 30 49.162 49.722 19.911 1.00 0.00 H new ATOM 0 HD11 ILE A 30 45.717 47.446 21.191 1.00 0.00 H new ATOM 0 HD12 ILE A 30 46.570 46.395 20.036 1.00 0.00 H new ATOM 0 HD13 ILE A 30 47.492 47.337 21.231 1.00 0.00 H new ATOM 490 N GLN A 31 49.355 48.852 15.706 1.00 0.00 N ATOM 491 CA GLN A 31 50.464 49.078 14.802 1.00 0.00 C ATOM 492 C GLN A 31 50.334 50.394 14.031 1.00 0.00 C ATOM 493 O GLN A 31 51.336 51.067 13.803 1.00 0.00 O ATOM 494 CB GLN A 31 50.603 47.883 13.864 1.00 0.00 C ATOM 495 CG GLN A 31 51.894 47.892 13.051 1.00 0.00 C ATOM 496 CD GLN A 31 52.051 46.665 12.149 1.00 0.00 C ATOM 497 OE1 GLN A 31 51.119 45.904 11.900 1.00 0.00 O ATOM 498 NE2 GLN A 31 53.257 46.404 11.651 1.00 0.00 N ATOM 0 H GLN A 31 48.798 48.030 15.471 1.00 0.00 H new ATOM 0 HA GLN A 31 51.374 49.173 15.394 1.00 0.00 H new ATOM 0 HB2 GLN A 31 50.559 46.965 14.450 1.00 0.00 H new ATOM 0 HB3 GLN A 31 49.754 47.867 13.181 1.00 0.00 H new ATOM 0 HG2 GLN A 31 51.922 48.792 12.436 1.00 0.00 H new ATOM 0 HG3 GLN A 31 52.744 47.945 13.732 1.00 0.00 H new ATOM 0 HE21 GLN A 31 54.038 47.029 11.851 1.00 0.00 H new ATOM 0 HE22 GLN A 31 53.401 45.579 11.069 1.00 0.00 H new ATOM 507 N ASP A 32 49.129 50.835 13.677 1.00 0.00 N ATOM 508 CA ASP A 32 48.914 52.129 13.060 1.00 0.00 C ATOM 509 C ASP A 32 49.013 53.298 14.041 1.00 0.00 C ATOM 510 O ASP A 32 49.536 54.354 13.690 1.00 0.00 O ATOM 511 CB ASP A 32 47.579 52.131 12.321 1.00 0.00 C ATOM 512 CG ASP A 32 47.466 53.369 11.428 1.00 0.00 C ATOM 513 OD1 ASP A 32 46.581 54.218 11.670 1.00 0.00 O ATOM 514 OD2 ASP A 32 48.263 53.481 10.470 1.00 0.00 O ATOM 0 H ASP A 32 48.273 50.297 13.814 1.00 0.00 H new ATOM 0 HA ASP A 32 49.724 52.284 12.347 1.00 0.00 H new ATOM 0 HB2 ASP A 32 47.490 51.229 11.716 1.00 0.00 H new ATOM 0 HB3 ASP A 32 46.759 52.116 13.039 1.00 0.00 H new ATOM 519 N LYS A 33 48.563 53.118 15.280 1.00 0.00 N ATOM 520 CA LYS A 33 48.686 54.085 16.351 1.00 0.00 C ATOM 521 C LYS A 33 50.132 54.303 16.800 1.00 0.00 C ATOM 522 O LYS A 33 50.513 55.450 17.026 1.00 0.00 O ATOM 523 CB LYS A 33 47.839 53.658 17.547 1.00 0.00 C ATOM 524 CG LYS A 33 46.326 53.679 17.346 1.00 0.00 C ATOM 525 CD LYS A 33 45.725 55.081 17.333 1.00 0.00 C ATOM 526 CE LYS A 33 44.224 54.991 17.071 1.00 0.00 C ATOM 527 NZ LYS A 33 43.615 56.316 16.884 1.00 0.00 N ATOM 0 H LYS A 33 48.087 52.263 15.569 1.00 0.00 H new ATOM 0 HA LYS A 33 48.326 55.034 15.953 1.00 0.00 H new ATOM 0 HB2 LYS A 33 48.132 52.647 17.831 1.00 0.00 H new ATOM 0 HB3 LYS A 33 48.082 54.308 18.388 1.00 0.00 H new ATOM 0 HG2 LYS A 33 46.087 53.183 16.405 1.00 0.00 H new ATOM 0 HG3 LYS A 33 45.855 53.100 18.140 1.00 0.00 H new ATOM 0 HD2 LYS A 33 45.909 55.576 18.287 1.00 0.00 H new ATOM 0 HD3 LYS A 33 46.203 55.686 16.563 1.00 0.00 H new ATOM 0 HE2 LYS A 33 44.047 54.383 16.184 1.00 0.00 H new ATOM 0 HE3 LYS A 33 43.740 54.485 17.906 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 42.596 56.208 16.709 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 43.760 56.889 17.740 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 44.058 56.790 16.071 1.00 0.00 H new ATOM 541 N GLU A 34 50.907 53.237 16.976 1.00 0.00 N ATOM 542 CA GLU A 34 52.136 53.222 17.743 1.00 0.00 C ATOM 543 C GLU A 34 53.301 52.483 17.080 1.00 0.00 C ATOM 544 O GLU A 34 54.403 52.449 17.626 1.00 0.00 O ATOM 545 CB GLU A 34 51.800 52.650 19.117 1.00 0.00 C ATOM 546 CG GLU A 34 52.834 52.810 20.228 1.00 0.00 C ATOM 547 CD GLU A 34 53.261 54.261 20.458 1.00 0.00 C ATOM 548 OE1 GLU A 34 52.428 55.183 20.320 1.00 0.00 O ATOM 549 OE2 GLU A 34 54.432 54.540 20.794 1.00 0.00 O ATOM 0 H GLU A 34 50.683 52.328 16.571 1.00 0.00 H new ATOM 0 HA GLU A 34 52.507 54.244 17.818 1.00 0.00 H new ATOM 0 HB2 GLU A 34 50.872 53.112 19.454 1.00 0.00 H new ATOM 0 HB3 GLU A 34 51.600 51.585 18.997 1.00 0.00 H new ATOM 0 HG2 GLU A 34 52.425 52.408 21.155 1.00 0.00 H new ATOM 0 HG3 GLU A 34 53.714 52.215 19.984 1.00 0.00 H new ATOM 556 N GLY A 35 53.115 51.871 15.914 1.00 0.00 N ATOM 557 CA GLY A 35 54.183 51.312 15.110 1.00 0.00 C ATOM 558 C GLY A 35 54.731 49.950 15.541 1.00 0.00 C ATOM 559 O GLY A 35 55.485 49.351 14.778 1.00 0.00 O ATOM 0 H GLY A 35 52.192 51.750 15.497 1.00 0.00 H new ATOM 0 HA2 GLY A 35 53.826 51.225 14.084 1.00 0.00 H new ATOM 0 HA3 GLY A 35 55.009 52.023 15.101 1.00 0.00 H new ATOM 563 N ILE A 36 54.354 49.446 16.712 1.00 0.00 N ATOM 564 CA ILE A 36 54.789 48.180 17.268 1.00 0.00 C ATOM 565 C ILE A 36 54.199 47.004 16.488 1.00 0.00 C ATOM 566 O ILE A 36 52.976 46.907 16.403 1.00 0.00 O ATOM 567 CB ILE A 36 54.490 48.145 18.764 1.00 0.00 C ATOM 568 CG1 ILE A 36 54.906 46.852 19.460 1.00 0.00 C ATOM 569 CG2 ILE A 36 53.038 48.441 19.129 1.00 0.00 C ATOM 570 CD1 ILE A 36 56.416 46.660 19.562 1.00 0.00 C ATOM 0 H ILE A 36 53.704 49.938 17.325 1.00 0.00 H new ATOM 0 HA ILE A 36 55.869 48.080 17.162 1.00 0.00 H new ATOM 0 HB ILE A 36 55.114 48.959 19.132 1.00 0.00 H new ATOM 0 HG12 ILE A 36 54.480 46.838 20.463 1.00 0.00 H new ATOM 0 HG13 ILE A 36 54.478 46.007 18.920 1.00 0.00 H new ATOM 0 HG21 ILE A 36 52.918 48.394 20.211 1.00 0.00 H new ATOM 0 HG22 ILE A 36 52.770 49.437 18.777 1.00 0.00 H new ATOM 0 HG23 ILE A 36 52.387 47.703 18.660 1.00 0.00 H new ATOM 0 HD11 ILE A 36 56.630 45.719 20.069 1.00 0.00 H new ATOM 0 HD12 ILE A 36 56.849 46.640 18.562 1.00 0.00 H new ATOM 0 HD13 ILE A 36 56.850 47.484 20.129 1.00 0.00 H new ATOM 582 N PRO A 37 54.986 46.099 15.912 1.00 0.00 N ATOM 583 CA PRO A 37 54.462 44.983 15.150 1.00 0.00 C ATOM 584 C PRO A 37 53.612 44.026 15.990 1.00 0.00 C ATOM 585 O PRO A 37 54.006 43.718 17.113 1.00 0.00 O ATOM 586 CB PRO A 37 55.657 44.260 14.539 1.00 0.00 C ATOM 587 CG PRO A 37 56.706 45.367 14.458 1.00 0.00 C ATOM 588 CD PRO A 37 56.422 46.156 15.733 1.00 0.00 C ATOM 0 HA PRO A 37 53.788 45.359 14.381 1.00 0.00 H new ATOM 0 HB2 PRO A 37 55.990 43.429 15.161 1.00 0.00 H new ATOM 0 HB3 PRO A 37 55.424 43.849 13.557 1.00 0.00 H new ATOM 0 HG2 PRO A 37 57.721 44.969 14.440 1.00 0.00 H new ATOM 0 HG3 PRO A 37 56.588 45.978 13.563 1.00 0.00 H new ATOM 0 HD2 PRO A 37 56.941 45.722 16.587 1.00 0.00 H new ATOM 0 HD3 PRO A 37 56.765 47.186 15.641 1.00 0.00 H new ATOM 596 N PRO A 38 52.481 43.528 15.500 1.00 0.00 N ATOM 597 CA PRO A 38 51.576 42.668 16.236 1.00 0.00 C ATOM 598 C PRO A 38 52.192 41.425 16.883 1.00 0.00 C ATOM 599 O PRO A 38 51.807 41.099 18.004 1.00 0.00 O ATOM 600 CB PRO A 38 50.481 42.297 15.241 1.00 0.00 C ATOM 601 CG PRO A 38 50.362 43.568 14.404 1.00 0.00 C ATOM 602 CD PRO A 38 51.825 43.986 14.292 1.00 0.00 C ATOM 0 HA PRO A 38 51.211 43.213 17.107 1.00 0.00 H new ATOM 0 HB2 PRO A 38 50.757 41.434 14.635 1.00 0.00 H new ATOM 0 HB3 PRO A 38 49.544 42.049 15.740 1.00 0.00 H new ATOM 0 HG2 PRO A 38 49.912 43.378 13.429 1.00 0.00 H new ATOM 0 HG3 PRO A 38 49.753 44.328 14.894 1.00 0.00 H new ATOM 0 HD2 PRO A 38 52.287 43.545 13.409 1.00 0.00 H new ATOM 0 HD3 PRO A 38 51.912 45.068 14.190 1.00 0.00 H new ATOM 610 N ASP A 39 53.183 40.776 16.279 1.00 0.00 N ATOM 611 CA ASP A 39 53.852 39.642 16.884 1.00 0.00 C ATOM 612 C ASP A 39 54.703 40.014 18.100 1.00 0.00 C ATOM 613 O ASP A 39 55.028 39.149 18.911 1.00 0.00 O ATOM 614 CB ASP A 39 54.674 38.879 15.849 1.00 0.00 C ATOM 615 CG ASP A 39 56.006 39.553 15.518 1.00 0.00 C ATOM 616 OD1 ASP A 39 55.998 40.674 14.963 1.00 0.00 O ATOM 617 OD2 ASP A 39 57.071 38.940 15.747 1.00 0.00 O ATOM 0 H ASP A 39 53.541 41.026 15.357 1.00 0.00 H new ATOM 0 HA ASP A 39 53.065 38.988 17.258 1.00 0.00 H new ATOM 0 HB2 ASP A 39 54.866 37.872 16.219 1.00 0.00 H new ATOM 0 HB3 ASP A 39 54.089 38.777 14.935 1.00 0.00 H new ATOM 622 N GLN A 40 55.027 41.292 18.277 1.00 0.00 N ATOM 623 CA GLN A 40 55.723 41.830 19.427 1.00 0.00 C ATOM 624 C GLN A 40 54.775 42.390 20.490 1.00 0.00 C ATOM 625 O GLN A 40 55.232 42.812 21.549 1.00 0.00 O ATOM 626 CB GLN A 40 56.732 42.885 18.982 1.00 0.00 C ATOM 627 CG GLN A 40 57.720 42.403 17.924 1.00 0.00 C ATOM 628 CD GLN A 40 58.759 43.464 17.556 1.00 0.00 C ATOM 629 OE1 GLN A 40 59.168 44.292 18.366 1.00 0.00 O ATOM 630 NE2 GLN A 40 59.228 43.493 16.311 1.00 0.00 N ATOM 0 H GLN A 40 54.798 42.008 17.587 1.00 0.00 H new ATOM 0 HA GLN A 40 56.253 41.003 19.899 1.00 0.00 H new ATOM 0 HB2 GLN A 40 56.191 43.746 18.591 1.00 0.00 H new ATOM 0 HB3 GLN A 40 57.290 43.228 19.854 1.00 0.00 H new ATOM 0 HG2 GLN A 40 58.231 41.512 18.289 1.00 0.00 H new ATOM 0 HG3 GLN A 40 57.172 42.111 17.028 1.00 0.00 H new ATOM 0 HE21 GLN A 40 58.899 42.813 15.626 1.00 0.00 H new ATOM 0 HE22 GLN A 40 59.917 44.196 16.042 1.00 0.00 H new ATOM 639 N GLN A 41 53.467 42.393 20.249 1.00 0.00 N ATOM 640 CA GLN A 41 52.468 42.881 21.179 1.00 0.00 C ATOM 641 C GLN A 41 51.913 41.732 22.025 1.00 0.00 C ATOM 642 O GLN A 41 51.279 40.828 21.486 1.00 0.00 O ATOM 643 CB GLN A 41 51.321 43.557 20.433 1.00 0.00 C ATOM 644 CG GLN A 41 51.659 44.796 19.609 1.00 0.00 C ATOM 645 CD GLN A 41 50.440 45.295 18.831 1.00 0.00 C ATOM 646 OE1 GLN A 41 49.295 45.141 19.250 1.00 0.00 O ATOM 647 NE2 GLN A 41 50.603 45.889 17.652 1.00 0.00 N ATOM 0 H GLN A 41 53.068 42.046 19.377 1.00 0.00 H new ATOM 0 HA GLN A 41 52.948 43.609 21.832 1.00 0.00 H new ATOM 0 HB2 GLN A 41 50.871 42.821 19.767 1.00 0.00 H new ATOM 0 HB3 GLN A 41 50.560 43.834 21.163 1.00 0.00 H new ATOM 0 HG2 GLN A 41 52.021 45.586 20.267 1.00 0.00 H new ATOM 0 HG3 GLN A 41 52.467 44.564 18.915 1.00 0.00 H new ATOM 0 HE21 GLN A 41 51.541 46.031 17.278 1.00 0.00 H new ATOM 0 HE22 GLN A 41 49.790 46.203 17.122 1.00 0.00 H new ATOM 656 N ARG A 42 52.093 41.788 23.341 1.00 0.00 N ATOM 657 CA ARG A 42 51.465 40.907 24.306 1.00 0.00 C ATOM 658 C ARG A 42 50.400 41.679 25.087 1.00 0.00 C ATOM 659 O ARG A 42 50.715 42.697 25.700 1.00 0.00 O ATOM 660 CB ARG A 42 52.559 40.325 25.196 1.00 0.00 C ATOM 661 CG ARG A 42 52.066 39.312 26.225 1.00 0.00 C ATOM 662 CD ARG A 42 53.279 38.809 27.004 1.00 0.00 C ATOM 663 NE ARG A 42 52.952 37.731 27.937 1.00 0.00 N ATOM 664 CZ ARG A 42 53.859 36.982 28.578 1.00 0.00 C ATOM 665 NH1 ARG A 42 55.175 37.177 28.421 1.00 0.00 N ATOM 666 NH2 ARG A 42 53.460 36.013 29.413 1.00 0.00 N ATOM 0 H ARG A 42 52.706 42.478 23.776 1.00 0.00 H new ATOM 0 HA ARG A 42 50.950 40.078 23.820 1.00 0.00 H new ATOM 0 HB2 ARG A 42 53.308 39.847 24.564 1.00 0.00 H new ATOM 0 HB3 ARG A 42 53.057 41.142 25.719 1.00 0.00 H new ATOM 0 HG2 ARG A 42 51.344 39.773 26.899 1.00 0.00 H new ATOM 0 HG3 ARG A 42 51.558 38.483 25.732 1.00 0.00 H new ATOM 0 HD2 ARG A 42 54.035 38.457 26.302 1.00 0.00 H new ATOM 0 HD3 ARG A 42 53.719 39.639 27.556 1.00 0.00 H new ATOM 0 HE ARG A 42 51.966 37.536 28.111 1.00 0.00 H new ATOM 0 HH11 ARG A 42 55.511 37.913 27.799 1.00 0.00 H new ATOM 0 HH12 ARG A 42 55.841 36.590 28.923 1.00 0.00 H new ATOM 0 HH21 ARG A 42 52.465 35.845 29.561 1.00 0.00 H new ATOM 0 HH22 ARG A 42 54.151 35.443 29.901 1.00 0.00 H new ATOM 680 N LEU A 43 49.151 41.224 25.060 1.00 0.00 N ATOM 681 CA LEU A 43 48.012 41.933 25.608 1.00 0.00 C ATOM 682 C LEU A 43 47.388 41.203 26.799 1.00 0.00 C ATOM 683 O LEU A 43 47.110 40.009 26.716 1.00 0.00 O ATOM 684 CB LEU A 43 46.997 42.201 24.500 1.00 0.00 C ATOM 685 CG LEU A 43 47.419 43.249 23.475 1.00 0.00 C ATOM 686 CD1 LEU A 43 46.421 43.251 22.321 1.00 0.00 C ATOM 687 CD2 LEU A 43 47.436 44.662 24.053 1.00 0.00 C ATOM 0 H LEU A 43 48.902 40.327 24.644 1.00 0.00 H new ATOM 0 HA LEU A 43 48.359 42.889 26.001 1.00 0.00 H new ATOM 0 HB2 LEU A 43 46.796 41.265 23.978 1.00 0.00 H new ATOM 0 HB3 LEU A 43 46.060 42.519 24.956 1.00 0.00 H new ATOM 0 HG LEU A 43 48.427 42.986 23.153 1.00 0.00 H new ATOM 0 HD11 LEU A 43 46.717 43.998 21.585 1.00 0.00 H new ATOM 0 HD12 LEU A 43 46.404 42.267 21.853 1.00 0.00 H new ATOM 0 HD13 LEU A 43 45.427 43.489 22.700 1.00 0.00 H new ATOM 0 HD21 LEU A 43 47.743 45.367 23.281 1.00 0.00 H new ATOM 0 HD22 LEU A 43 46.438 44.923 24.406 1.00 0.00 H new ATOM 0 HD23 LEU A 43 48.139 44.706 24.885 1.00 0.00 H new ATOM 699 N ILE A 44 47.156 41.933 27.887 1.00 0.00 N ATOM 700 CA ILE A 44 46.694 41.427 29.163 1.00 0.00 C ATOM 701 C ILE A 44 45.496 42.242 29.653 1.00 0.00 C ATOM 702 O ILE A 44 45.507 43.470 29.606 1.00 0.00 O ATOM 703 CB ILE A 44 47.834 41.406 30.177 1.00 0.00 C ATOM 704 CG1 ILE A 44 48.984 40.523 29.700 1.00 0.00 C ATOM 705 CG2 ILE A 44 47.351 40.940 31.548 1.00 0.00 C ATOM 706 CD1 ILE A 44 50.236 40.554 30.571 1.00 0.00 C ATOM 0 H ILE A 44 47.294 42.944 27.896 1.00 0.00 H new ATOM 0 HA ILE A 44 46.359 40.397 29.040 1.00 0.00 H new ATOM 0 HB ILE A 44 48.199 42.429 30.270 1.00 0.00 H new ATOM 0 HG12 ILE A 44 48.629 39.494 29.640 1.00 0.00 H new ATOM 0 HG13 ILE A 44 49.257 40.826 28.689 1.00 0.00 H new ATOM 0 HG21 ILE A 44 48.188 40.937 32.247 1.00 0.00 H new ATOM 0 HG22 ILE A 44 46.578 41.617 31.911 1.00 0.00 H new ATOM 0 HG23 ILE A 44 46.942 39.933 31.467 1.00 0.00 H new ATOM 0 HD11 ILE A 44 50.992 39.894 30.145 1.00 0.00 H new ATOM 0 HD12 ILE A 44 50.625 41.571 30.613 1.00 0.00 H new ATOM 0 HD13 ILE A 44 49.987 40.219 31.578 1.00 0.00 H new ATOM 718 N PHE A 45 44.462 41.555 30.132 1.00 0.00 N ATOM 719 CA PHE A 45 43.262 42.126 30.709 1.00 0.00 C ATOM 720 C PHE A 45 42.571 41.123 31.634 1.00 0.00 C ATOM 721 O PHE A 45 42.484 39.941 31.307 1.00 0.00 O ATOM 722 CB PHE A 45 42.331 42.544 29.575 1.00 0.00 C ATOM 723 CG PHE A 45 40.988 43.093 29.993 1.00 0.00 C ATOM 724 CD1 PHE A 45 40.897 44.384 30.527 1.00 0.00 C ATOM 725 CD2 PHE A 45 39.829 42.325 29.829 1.00 0.00 C ATOM 726 CE1 PHE A 45 39.652 44.916 30.883 1.00 0.00 C ATOM 727 CE2 PHE A 45 38.585 42.851 30.196 1.00 0.00 C ATOM 728 CZ PHE A 45 38.494 44.147 30.719 1.00 0.00 C ATOM 0 H PHE A 45 44.444 40.535 30.125 1.00 0.00 H new ATOM 0 HA PHE A 45 43.524 42.996 31.311 1.00 0.00 H new ATOM 0 HB2 PHE A 45 42.839 43.298 28.973 1.00 0.00 H new ATOM 0 HB3 PHE A 45 42.164 41.681 28.931 1.00 0.00 H new ATOM 0 HD1 PHE A 45 41.792 44.973 30.665 1.00 0.00 H new ATOM 0 HD2 PHE A 45 39.895 41.328 29.420 1.00 0.00 H new ATOM 0 HE1 PHE A 45 39.585 45.917 31.283 1.00 0.00 H new ATOM 0 HE2 PHE A 45 37.692 42.255 30.075 1.00 0.00 H new ATOM 0 HZ PHE A 45 37.532 44.552 30.995 1.00 0.00 H new ATOM 738 N ALA A 46 42.059 41.582 32.772 1.00 0.00 N ATOM 739 CA ALA A 46 41.378 40.784 33.772 1.00 0.00 C ATOM 740 C ALA A 46 42.148 39.526 34.177 1.00 0.00 C ATOM 741 O ALA A 46 41.636 38.411 34.118 1.00 0.00 O ATOM 742 CB ALA A 46 39.936 40.540 33.334 1.00 0.00 C ATOM 0 H ALA A 46 42.113 42.568 33.029 1.00 0.00 H new ATOM 0 HA ALA A 46 41.340 41.349 34.704 1.00 0.00 H new ATOM 0 HB1 ALA A 46 39.424 39.940 34.086 1.00 0.00 H new ATOM 0 HB2 ALA A 46 39.423 41.495 33.221 1.00 0.00 H new ATOM 0 HB3 ALA A 46 39.930 40.010 32.381 1.00 0.00 H new ATOM 748 N GLY A 47 43.418 39.695 34.536 1.00 0.00 N ATOM 749 CA GLY A 47 44.289 38.655 35.045 1.00 0.00 C ATOM 750 C GLY A 47 44.769 37.617 34.029 1.00 0.00 C ATOM 751 O GLY A 47 45.360 36.625 34.448 1.00 0.00 O ATOM 0 H GLY A 47 43.882 40.601 34.475 1.00 0.00 H new ATOM 0 HA2 GLY A 47 45.164 39.129 35.490 1.00 0.00 H new ATOM 0 HA3 GLY A 47 43.767 38.133 35.847 1.00 0.00 H new ATOM 755 N LYS A 48 44.487 37.793 32.740 1.00 0.00 N ATOM 756 CA LYS A 48 44.662 36.794 31.704 1.00 0.00 C ATOM 757 C LYS A 48 45.144 37.401 30.385 1.00 0.00 C ATOM 758 O LYS A 48 45.002 38.600 30.154 1.00 0.00 O ATOM 759 CB LYS A 48 43.338 36.058 31.516 1.00 0.00 C ATOM 760 CG LYS A 48 42.889 35.248 32.727 1.00 0.00 C ATOM 761 CD LYS A 48 41.580 34.494 32.504 1.00 0.00 C ATOM 762 CE LYS A 48 40.382 35.385 32.192 1.00 0.00 C ATOM 763 NZ LYS A 48 40.030 36.256 33.324 1.00 0.00 N ATOM 0 H LYS A 48 44.116 38.673 32.381 1.00 0.00 H new ATOM 0 HA LYS A 48 45.439 36.097 32.017 1.00 0.00 H new ATOM 0 HB2 LYS A 48 42.563 36.786 31.274 1.00 0.00 H new ATOM 0 HB3 LYS A 48 43.427 35.389 30.660 1.00 0.00 H new ATOM 0 HG2 LYS A 48 43.671 34.534 32.987 1.00 0.00 H new ATOM 0 HG3 LYS A 48 42.773 35.918 33.579 1.00 0.00 H new ATOM 0 HD2 LYS A 48 41.716 33.790 31.683 1.00 0.00 H new ATOM 0 HD3 LYS A 48 41.358 33.906 33.395 1.00 0.00 H new ATOM 0 HE2 LYS A 48 40.605 35.998 31.319 1.00 0.00 H new ATOM 0 HE3 LYS A 48 39.525 34.762 31.934 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 39.117 36.718 33.136 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 39.958 35.686 34.191 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 40.766 36.981 33.446 1.00 0.00 H new ATOM 777 N GLN A 49 45.683 36.574 29.494 1.00 0.00 N ATOM 778 CA GLN A 49 46.119 36.969 28.169 1.00 0.00 C ATOM 779 C GLN A 49 44.960 37.036 27.173 1.00 0.00 C ATOM 780 O GLN A 49 44.056 36.204 27.196 1.00 0.00 O ATOM 781 CB GLN A 49 47.215 36.040 27.656 1.00 0.00 C ATOM 782 CG GLN A 49 48.485 36.081 28.503 1.00 0.00 C ATOM 783 CD GLN A 49 49.668 35.359 27.856 1.00 0.00 C ATOM 784 OE1 GLN A 49 50.594 35.972 27.328 1.00 0.00 O ATOM 785 NE2 GLN A 49 49.709 34.030 27.887 1.00 0.00 N ATOM 0 H GLN A 49 45.830 35.583 29.685 1.00 0.00 H new ATOM 0 HA GLN A 49 46.528 37.976 28.257 1.00 0.00 H new ATOM 0 HB2 GLN A 49 46.835 35.019 27.632 1.00 0.00 H new ATOM 0 HB3 GLN A 49 47.462 36.312 26.630 1.00 0.00 H new ATOM 0 HG2 GLN A 49 48.758 37.120 28.685 1.00 0.00 H new ATOM 0 HG3 GLN A 49 48.280 35.630 29.474 1.00 0.00 H new ATOM 0 HE21 GLN A 49 48.949 33.506 28.321 1.00 0.00 H new ATOM 0 HE22 GLN A 49 50.500 33.534 27.477 1.00 0.00 H new ATOM 794 N LEU A 50 45.018 38.001 26.259 1.00 0.00 N ATOM 795 CA LEU A 50 44.100 38.148 25.149 1.00 0.00 C ATOM 796 C LEU A 50 44.663 37.500 23.883 1.00 0.00 C ATOM 797 O LEU A 50 45.765 37.841 23.459 1.00 0.00 O ATOM 798 CB LEU A 50 43.793 39.627 24.932 1.00 0.00 C ATOM 799 CG LEU A 50 43.181 40.367 26.119 1.00 0.00 C ATOM 800 CD1 LEU A 50 42.963 41.835 25.759 1.00 0.00 C ATOM 801 CD2 LEU A 50 41.821 39.801 26.514 1.00 0.00 C ATOM 0 H LEU A 50 45.735 38.726 26.278 1.00 0.00 H new ATOM 0 HA LEU A 50 43.169 37.632 25.385 1.00 0.00 H new ATOM 0 HB2 LEU A 50 44.718 40.132 24.653 1.00 0.00 H new ATOM 0 HB3 LEU A 50 43.113 39.716 24.085 1.00 0.00 H new ATOM 0 HG LEU A 50 43.878 40.251 26.949 1.00 0.00 H new ATOM 0 HD11 LEU A 50 42.526 42.357 26.610 1.00 0.00 H new ATOM 0 HD12 LEU A 50 43.919 42.293 25.504 1.00 0.00 H new ATOM 0 HD13 LEU A 50 42.288 41.904 24.906 1.00 0.00 H new ATOM 0 HD21 LEU A 50 41.427 40.360 27.362 1.00 0.00 H new ATOM 0 HD22 LEU A 50 41.133 39.886 25.673 1.00 0.00 H new ATOM 0 HD23 LEU A 50 41.930 38.752 26.790 1.00 0.00 H new ATOM 813 N GLU A 51 43.917 36.580 23.278 1.00 0.00 N ATOM 814 CA GLU A 51 44.336 35.793 22.134 1.00 0.00 C ATOM 815 C GLU A 51 43.786 36.319 20.807 1.00 0.00 C ATOM 816 O GLU A 51 42.622 36.702 20.709 1.00 0.00 O ATOM 817 CB GLU A 51 43.933 34.330 22.297 1.00 0.00 C ATOM 818 CG GLU A 51 44.601 33.653 23.490 1.00 0.00 C ATOM 819 CD GLU A 51 43.909 32.322 23.794 1.00 0.00 C ATOM 820 OE1 GLU A 51 43.878 31.422 22.926 1.00 0.00 O ATOM 821 OE2 GLU A 51 43.381 32.172 24.916 1.00 0.00 O ATOM 0 H GLU A 51 42.970 36.358 23.586 1.00 0.00 H new ATOM 0 HA GLU A 51 45.422 35.879 22.101 1.00 0.00 H new ATOM 0 HB2 GLU A 51 42.851 34.268 22.411 1.00 0.00 H new ATOM 0 HB3 GLU A 51 44.189 33.786 21.388 1.00 0.00 H new ATOM 0 HG2 GLU A 51 45.657 33.483 23.278 1.00 0.00 H new ATOM 0 HG3 GLU A 51 44.552 34.305 24.362 1.00 0.00 H new ATOM 828 N ASP A 52 44.619 36.277 19.771 1.00 0.00 N ATOM 829 CA ASP A 52 44.406 36.919 18.489 1.00 0.00 C ATOM 830 C ASP A 52 43.124 36.522 17.754 1.00 0.00 C ATOM 831 O ASP A 52 42.486 37.397 17.172 1.00 0.00 O ATOM 832 CB ASP A 52 45.636 36.656 17.627 1.00 0.00 C ATOM 833 CG ASP A 52 46.753 37.670 17.881 1.00 0.00 C ATOM 834 OD1 ASP A 52 47.297 38.219 16.900 1.00 0.00 O ATOM 835 OD2 ASP A 52 47.155 37.882 19.046 1.00 0.00 O ATOM 0 H ASP A 52 45.502 35.768 19.810 1.00 0.00 H new ATOM 0 HA ASP A 52 44.265 37.982 18.685 1.00 0.00 H new ATOM 0 HB2 ASP A 52 46.009 35.651 17.827 1.00 0.00 H new ATOM 0 HB3 ASP A 52 45.353 36.687 16.575 1.00 0.00 H new ATOM 840 N GLY A 53 42.724 35.254 17.810 1.00 0.00 N ATOM 841 CA GLY A 53 41.587 34.731 17.080 1.00 0.00 C ATOM 842 C GLY A 53 40.212 34.966 17.707 1.00 0.00 C ATOM 843 O GLY A 53 39.218 34.589 17.089 1.00 0.00 O ATOM 0 H GLY A 53 43.196 34.551 18.379 1.00 0.00 H new ATOM 0 HA2 GLY A 53 41.588 35.172 16.083 1.00 0.00 H new ATOM 0 HA3 GLY A 53 41.726 33.657 16.954 1.00 0.00 H new ATOM 847 N ARG A 54 40.135 35.548 18.900 1.00 0.00 N ATOM 848 CA ARG A 54 38.916 35.778 19.649 1.00 0.00 C ATOM 849 C ARG A 54 38.520 37.257 19.653 1.00 0.00 C ATOM 850 O ARG A 54 39.310 38.105 19.243 1.00 0.00 O ATOM 851 CB ARG A 54 39.039 35.190 21.051 1.00 0.00 C ATOM 852 CG ARG A 54 39.313 33.689 21.038 1.00 0.00 C ATOM 853 CD ARG A 54 39.200 33.044 22.416 1.00 0.00 C ATOM 854 NE ARG A 54 37.811 32.897 22.854 1.00 0.00 N ATOM 855 CZ ARG A 54 37.374 32.884 24.120 1.00 0.00 C ATOM 856 NH1 ARG A 54 38.173 33.023 25.187 1.00 0.00 N ATOM 857 NH2 ARG A 54 36.074 32.723 24.403 1.00 0.00 N ATOM 0 H ARG A 54 40.964 35.886 19.389 1.00 0.00 H new ATOM 0 HA ARG A 54 38.098 35.258 19.150 1.00 0.00 H new ATOM 0 HB2 ARG A 54 39.843 35.697 21.584 1.00 0.00 H new ATOM 0 HB3 ARG A 54 38.119 35.383 21.603 1.00 0.00 H new ATOM 0 HG2 ARG A 54 38.612 33.204 20.359 1.00 0.00 H new ATOM 0 HG3 ARG A 54 40.313 33.512 20.643 1.00 0.00 H new ATOM 0 HD2 ARG A 54 39.677 32.064 22.395 1.00 0.00 H new ATOM 0 HD3 ARG A 54 39.745 33.648 23.142 1.00 0.00 H new ATOM 0 HE ARG A 54 37.107 32.794 22.123 1.00 0.00 H new ATOM 0 HH11 ARG A 54 39.177 33.148 25.059 1.00 0.00 H new ATOM 0 HH12 ARG A 54 37.777 33.004 26.127 1.00 0.00 H new ATOM 0 HH21 ARG A 54 35.398 32.608 23.648 1.00 0.00 H new ATOM 0 HH22 ARG A 54 35.760 32.716 25.374 1.00 0.00 H new ATOM 871 N THR A 55 37.294 37.576 20.056 1.00 0.00 N ATOM 872 CA THR A 55 36.735 38.911 19.986 1.00 0.00 C ATOM 873 C THR A 55 36.788 39.693 21.299 1.00 0.00 C ATOM 874 O THR A 55 36.885 39.117 22.380 1.00 0.00 O ATOM 875 CB THR A 55 35.312 38.938 19.435 1.00 0.00 C ATOM 876 OG1 THR A 55 34.392 38.339 20.318 1.00 0.00 O ATOM 877 CG2 THR A 55 35.187 38.242 18.082 1.00 0.00 C ATOM 0 H THR A 55 36.649 36.891 20.450 1.00 0.00 H new ATOM 0 HA THR A 55 37.395 39.417 19.282 1.00 0.00 H new ATOM 0 HB THR A 55 35.079 39.996 19.315 1.00 0.00 H new ATOM 0 HG1 THR A 55 34.558 37.374 20.358 1.00 0.00 H new ATOM 0 HG21 THR A 55 34.153 38.293 17.741 1.00 0.00 H new ATOM 0 HG22 THR A 55 35.833 38.737 17.357 1.00 0.00 H new ATOM 0 HG23 THR A 55 35.485 37.198 18.181 1.00 0.00 H new ATOM 885 N LEU A 56 36.658 41.014 21.212 1.00 0.00 N ATOM 886 CA LEU A 56 36.485 41.875 22.365 1.00 0.00 C ATOM 887 C LEU A 56 35.295 41.447 23.226 1.00 0.00 C ATOM 888 O LEU A 56 35.395 41.459 24.452 1.00 0.00 O ATOM 889 CB LEU A 56 36.318 43.321 21.909 1.00 0.00 C ATOM 890 CG LEU A 56 37.512 43.945 21.192 1.00 0.00 C ATOM 891 CD1 LEU A 56 37.155 45.376 20.803 1.00 0.00 C ATOM 892 CD2 LEU A 56 38.774 44.006 22.048 1.00 0.00 C ATOM 0 H LEU A 56 36.671 41.517 20.325 1.00 0.00 H new ATOM 0 HA LEU A 56 37.378 41.789 22.984 1.00 0.00 H new ATOM 0 HB2 LEU A 56 35.455 43.373 21.246 1.00 0.00 H new ATOM 0 HB3 LEU A 56 36.086 43.931 22.782 1.00 0.00 H new ATOM 0 HG LEU A 56 37.723 43.312 20.330 1.00 0.00 H new ATOM 0 HD11 LEU A 56 38.000 45.835 20.289 1.00 0.00 H new ATOM 0 HD12 LEU A 56 36.289 45.368 20.141 1.00 0.00 H new ATOM 0 HD13 LEU A 56 36.921 45.949 21.700 1.00 0.00 H new ATOM 0 HD21 LEU A 56 39.581 44.461 21.474 1.00 0.00 H new ATOM 0 HD22 LEU A 56 38.581 44.603 22.939 1.00 0.00 H new ATOM 0 HD23 LEU A 56 39.063 42.997 22.343 1.00 0.00 H new ATOM 904 N SER A 57 34.201 41.016 22.605 1.00 0.00 N ATOM 905 CA SER A 57 33.025 40.509 23.284 1.00 0.00 C ATOM 906 C SER A 57 33.257 39.182 24.010 1.00 0.00 C ATOM 907 O SER A 57 32.760 39.019 25.122 1.00 0.00 O ATOM 908 CB SER A 57 31.876 40.388 22.287 1.00 0.00 C ATOM 909 OG SER A 57 30.666 40.096 22.949 1.00 0.00 O ATOM 0 H SER A 57 34.111 41.012 21.589 1.00 0.00 H new ATOM 0 HA SER A 57 32.772 41.228 24.064 1.00 0.00 H new ATOM 0 HB2 SER A 57 31.774 41.318 21.728 1.00 0.00 H new ATOM 0 HB3 SER A 57 32.098 39.604 21.563 1.00 0.00 H new ATOM 0 HG SER A 57 29.943 40.024 22.292 1.00 0.00 H new ATOM 915 N ASP A 58 34.064 38.270 23.476 1.00 0.00 N ATOM 916 CA ASP A 58 34.451 37.059 24.173 1.00 0.00 C ATOM 917 C ASP A 58 35.182 37.358 25.483 1.00 0.00 C ATOM 918 O ASP A 58 34.991 36.666 26.480 1.00 0.00 O ATOM 919 CB ASP A 58 35.365 36.190 23.316 1.00 0.00 C ATOM 920 CG ASP A 58 34.670 35.596 22.089 1.00 0.00 C ATOM 921 OD1 ASP A 58 35.087 35.919 20.955 1.00 0.00 O ATOM 922 OD2 ASP A 58 33.707 34.817 22.264 1.00 0.00 O ATOM 0 H ASP A 58 34.467 38.356 22.543 1.00 0.00 H new ATOM 0 HA ASP A 58 33.522 36.531 24.387 1.00 0.00 H new ATOM 0 HB2 ASP A 58 36.217 36.786 22.988 1.00 0.00 H new ATOM 0 HB3 ASP A 58 35.760 35.379 23.928 1.00 0.00 H new ATOM 927 N TYR A 59 35.983 38.420 25.491 1.00 0.00 N ATOM 928 CA TYR A 59 36.689 38.921 26.652 1.00 0.00 C ATOM 929 C TYR A 59 35.916 39.974 27.450 1.00 0.00 C ATOM 930 O TYR A 59 36.473 40.504 28.410 1.00 0.00 O ATOM 931 CB TYR A 59 38.081 39.372 26.221 1.00 0.00 C ATOM 932 CG TYR A 59 38.936 38.250 25.685 1.00 0.00 C ATOM 933 CD1 TYR A 59 39.235 37.162 26.514 1.00 0.00 C ATOM 934 CD2 TYR A 59 39.450 38.299 24.383 1.00 0.00 C ATOM 935 CE1 TYR A 59 40.034 36.113 26.045 1.00 0.00 C ATOM 936 CE2 TYR A 59 40.301 37.289 23.921 1.00 0.00 C ATOM 937 CZ TYR A 59 40.589 36.188 24.752 1.00 0.00 C ATOM 938 OH TYR A 59 41.413 35.190 24.319 1.00 0.00 O ATOM 0 H TYR A 59 36.161 38.972 24.652 1.00 0.00 H new ATOM 0 HA TYR A 59 36.791 38.107 27.370 1.00 0.00 H new ATOM 0 HB2 TYR A 59 37.984 40.142 25.456 1.00 0.00 H new ATOM 0 HB3 TYR A 59 38.586 39.829 27.072 1.00 0.00 H new ATOM 0 HD1 TYR A 59 38.847 37.132 27.521 1.00 0.00 H new ATOM 0 HD2 TYR A 59 39.188 39.120 23.732 1.00 0.00 H new ATOM 0 HE1 TYR A 59 40.224 35.252 26.669 1.00 0.00 H new ATOM 0 HE2 TYR A 59 40.734 37.353 22.934 1.00 0.00 H new ATOM 0 HH TYR A 59 41.157 34.346 24.746 1.00 0.00 H new ATOM 948 N ASN A 60 34.657 40.235 27.116 1.00 0.00 N ATOM 949 CA ASN A 60 33.781 41.158 27.811 1.00 0.00 C ATOM 950 C ASN A 60 34.355 42.569 27.946 1.00 0.00 C ATOM 951 O ASN A 60 34.189 43.238 28.963 1.00 0.00 O ATOM 952 CB ASN A 60 33.354 40.516 29.128 1.00 0.00 C ATOM 953 CG ASN A 60 32.183 41.196 29.842 1.00 0.00 C ATOM 954 OD1 ASN A 60 31.375 41.923 29.268 1.00 0.00 O ATOM 955 ND2 ASN A 60 32.041 40.906 31.132 1.00 0.00 N ATOM 0 H ASN A 60 34.204 39.788 26.319 1.00 0.00 H new ATOM 0 HA ASN A 60 32.889 41.330 27.209 1.00 0.00 H new ATOM 0 HB2 ASN A 60 33.086 39.477 28.936 1.00 0.00 H new ATOM 0 HB3 ASN A 60 34.211 40.505 29.802 1.00 0.00 H new ATOM 0 HD21 ASN A 60 31.254 41.288 31.657 1.00 0.00 H new ATOM 0 HD22 ASN A 60 32.719 40.301 31.596 1.00 0.00 H new ATOM 962 N ILE A 61 35.061 43.036 26.919 1.00 0.00 N ATOM 963 CA ILE A 61 35.660 44.355 26.886 1.00 0.00 C ATOM 964 C ILE A 61 34.561 45.345 26.496 1.00 0.00 C ATOM 965 O ILE A 61 34.091 45.357 25.360 1.00 0.00 O ATOM 966 CB ILE A 61 36.891 44.351 25.986 1.00 0.00 C ATOM 967 CG1 ILE A 61 37.980 43.463 26.579 1.00 0.00 C ATOM 968 CG2 ILE A 61 37.414 45.771 25.784 1.00 0.00 C ATOM 969 CD1 ILE A 61 39.103 43.106 25.608 1.00 0.00 C ATOM 0 H ILE A 61 35.232 42.492 26.073 1.00 0.00 H new ATOM 0 HA ILE A 61 36.043 44.669 27.857 1.00 0.00 H new ATOM 0 HB ILE A 61 36.605 43.949 25.014 1.00 0.00 H new ATOM 0 HG12 ILE A 61 38.411 43.967 27.444 1.00 0.00 H new ATOM 0 HG13 ILE A 61 37.523 42.542 26.941 1.00 0.00 H new ATOM 0 HG21 ILE A 61 38.292 45.747 25.139 1.00 0.00 H new ATOM 0 HG22 ILE A 61 36.639 46.381 25.320 1.00 0.00 H new ATOM 0 HG23 ILE A 61 37.684 46.200 26.749 1.00 0.00 H new ATOM 0 HD11 ILE A 61 39.833 42.473 26.113 1.00 0.00 H new ATOM 0 HD12 ILE A 61 38.689 42.572 24.753 1.00 0.00 H new ATOM 0 HD13 ILE A 61 39.590 44.018 25.264 1.00 0.00 H new ATOM 981 N GLN A 62 34.110 46.126 27.474 1.00 0.00 N ATOM 982 CA GLN A 62 33.092 47.150 27.354 1.00 0.00 C ATOM 983 C GLN A 62 33.724 48.521 27.104 1.00 0.00 C ATOM 984 O GLN A 62 34.941 48.675 27.189 1.00 0.00 O ATOM 985 CB GLN A 62 32.246 47.143 28.624 1.00 0.00 C ATOM 986 CG GLN A 62 31.536 45.833 28.955 1.00 0.00 C ATOM 987 CD GLN A 62 30.334 45.481 28.077 1.00 0.00 C ATOM 988 OE1 GLN A 62 29.761 46.301 27.362 1.00 0.00 O ATOM 989 NE2 GLN A 62 29.871 44.235 28.114 1.00 0.00 N ATOM 0 H GLN A 62 34.471 46.052 28.425 1.00 0.00 H new ATOM 0 HA GLN A 62 32.452 46.940 26.497 1.00 0.00 H new ATOM 0 HB2 GLN A 62 32.888 47.406 29.465 1.00 0.00 H new ATOM 0 HB3 GLN A 62 31.494 47.928 28.539 1.00 0.00 H new ATOM 0 HG2 GLN A 62 32.261 45.022 28.886 1.00 0.00 H new ATOM 0 HG3 GLN A 62 31.203 45.875 29.992 1.00 0.00 H new ATOM 0 HE21 GLN A 62 30.330 43.538 28.700 1.00 0.00 H new ATOM 0 HE22 GLN A 62 29.057 43.977 27.557 1.00 0.00 H new ATOM 998 N LYS A 63 32.916 49.545 26.841 1.00 0.00 N ATOM 999 CA LYS A 63 33.346 50.914 26.647 1.00 0.00 C ATOM 1000 C LYS A 63 34.257 51.420 27.767 1.00 0.00 C ATOM 1001 O LYS A 63 34.099 51.055 28.930 1.00 0.00 O ATOM 1002 CB LYS A 63 32.152 51.846 26.457 1.00 0.00 C ATOM 1003 CG LYS A 63 31.182 51.931 27.632 1.00 0.00 C ATOM 1004 CD LYS A 63 30.161 53.057 27.507 1.00 0.00 C ATOM 1005 CE LYS A 63 30.798 54.421 27.756 1.00 0.00 C ATOM 1006 NZ LYS A 63 29.800 55.490 27.910 1.00 0.00 N ATOM 0 H LYS A 63 31.906 49.432 26.755 1.00 0.00 H new ATOM 0 HA LYS A 63 33.941 50.919 25.734 1.00 0.00 H new ATOM 0 HB2 LYS A 63 32.527 52.848 26.247 1.00 0.00 H new ATOM 0 HB3 LYS A 63 31.598 51.521 25.576 1.00 0.00 H new ATOM 0 HG2 LYS A 63 30.653 50.982 27.724 1.00 0.00 H new ATOM 0 HG3 LYS A 63 31.751 52.069 28.551 1.00 0.00 H new ATOM 0 HD2 LYS A 63 29.717 53.038 26.512 1.00 0.00 H new ATOM 0 HD3 LYS A 63 29.352 52.897 28.220 1.00 0.00 H new ATOM 0 HE2 LYS A 63 31.414 54.372 28.654 1.00 0.00 H new ATOM 0 HE3 LYS A 63 31.462 54.665 26.927 1.00 0.00 H new ATOM 0 HZ1 LYS A 63 30.284 56.395 28.077 1.00 0.00 H new ATOM 0 HZ2 LYS A 63 29.228 55.558 27.044 1.00 0.00 H new ATOM 0 HZ3 LYS A 63 29.182 55.274 28.718 1.00 0.00 H new ATOM 1020 N GLU A 64 35.191 52.296 27.408 1.00 0.00 N ATOM 1021 CA GLU A 64 36.140 52.947 28.290 1.00 0.00 C ATOM 1022 C GLU A 64 37.127 52.018 28.998 1.00 0.00 C ATOM 1023 O GLU A 64 37.883 52.478 29.851 1.00 0.00 O ATOM 1024 CB GLU A 64 35.443 53.888 29.269 1.00 0.00 C ATOM 1025 CG GLU A 64 34.214 54.639 28.764 1.00 0.00 C ATOM 1026 CD GLU A 64 34.492 55.536 27.556 1.00 0.00 C ATOM 1027 OE1 GLU A 64 33.773 55.447 26.538 1.00 0.00 O ATOM 1028 OE2 GLU A 64 35.364 56.424 27.678 1.00 0.00 O ATOM 0 H GLU A 64 35.308 52.583 26.436 1.00 0.00 H new ATOM 0 HA GLU A 64 36.766 53.539 27.623 1.00 0.00 H new ATOM 0 HB2 GLU A 64 35.148 53.307 30.143 1.00 0.00 H new ATOM 0 HB3 GLU A 64 36.173 54.624 29.607 1.00 0.00 H new ATOM 0 HG2 GLU A 64 33.442 53.917 28.499 1.00 0.00 H new ATOM 0 HG3 GLU A 64 33.814 55.249 29.574 1.00 0.00 H new ATOM 1035 N SER A 65 37.150 50.727 28.679 1.00 0.00 N ATOM 1036 CA SER A 65 38.063 49.774 29.276 1.00 0.00 C ATOM 1037 C SER A 65 39.524 50.057 28.920 1.00 0.00 C ATOM 1038 O SER A 65 39.821 50.418 27.784 1.00 0.00 O ATOM 1039 CB SER A 65 37.761 48.338 28.858 1.00 0.00 C ATOM 1040 OG SER A 65 36.459 47.940 29.224 1.00 0.00 O ATOM 0 H SER A 65 36.524 50.314 27.988 1.00 0.00 H new ATOM 0 HA SER A 65 37.915 49.889 30.350 1.00 0.00 H new ATOM 0 HB2 SER A 65 37.878 48.243 27.778 1.00 0.00 H new ATOM 0 HB3 SER A 65 38.487 47.667 29.318 1.00 0.00 H new ATOM 0 HG SER A 65 35.820 48.253 28.550 1.00 0.00 H new ATOM 1046 N THR A 66 40.439 49.822 29.857 1.00 0.00 N ATOM 1047 CA THR A 66 41.871 49.899 29.652 1.00 0.00 C ATOM 1048 C THR A 66 42.476 48.496 29.584 1.00 0.00 C ATOM 1049 O THR A 66 42.277 47.683 30.485 1.00 0.00 O ATOM 1050 CB THR A 66 42.556 50.726 30.738 1.00 0.00 C ATOM 1051 OG1 THR A 66 42.056 52.045 30.728 1.00 0.00 O ATOM 1052 CG2 THR A 66 44.061 50.861 30.529 1.00 0.00 C ATOM 0 H THR A 66 40.188 49.564 30.811 1.00 0.00 H new ATOM 0 HA THR A 66 42.041 50.404 28.701 1.00 0.00 H new ATOM 0 HB THR A 66 42.356 50.200 31.671 1.00 0.00 H new ATOM 0 HG1 THR A 66 42.499 52.568 31.428 1.00 0.00 H new ATOM 0 HG21 THR A 66 44.488 51.459 31.334 1.00 0.00 H new ATOM 0 HG22 THR A 66 44.519 49.872 30.530 1.00 0.00 H new ATOM 0 HG23 THR A 66 44.253 51.348 29.573 1.00 0.00 H new ATOM 1060 N LEU A 67 43.257 48.230 28.541 1.00 0.00 N ATOM 1061 CA LEU A 67 44.008 47.012 28.313 1.00 0.00 C ATOM 1062 C LEU A 67 45.500 47.281 28.525 1.00 0.00 C ATOM 1063 O LEU A 67 45.978 48.382 28.262 1.00 0.00 O ATOM 1064 CB LEU A 67 43.738 46.481 26.908 1.00 0.00 C ATOM 1065 CG LEU A 67 42.289 46.482 26.431 1.00 0.00 C ATOM 1066 CD1 LEU A 67 42.215 45.928 25.010 1.00 0.00 C ATOM 1067 CD2 LEU A 67 41.361 45.649 27.311 1.00 0.00 C ATOM 0 H LEU A 67 43.386 48.906 27.788 1.00 0.00 H new ATOM 0 HA LEU A 67 43.690 46.250 29.025 1.00 0.00 H new ATOM 0 HB2 LEU A 67 44.326 47.071 26.205 1.00 0.00 H new ATOM 0 HB3 LEU A 67 44.111 45.458 26.856 1.00 0.00 H new ATOM 0 HG LEU A 67 41.955 47.518 26.478 1.00 0.00 H new ATOM 0 HD11 LEU A 67 41.179 45.930 24.672 1.00 0.00 H new ATOM 0 HD12 LEU A 67 42.815 46.550 24.345 1.00 0.00 H new ATOM 0 HD13 LEU A 67 42.599 44.908 24.997 1.00 0.00 H new ATOM 0 HD21 LEU A 67 40.347 45.694 26.915 1.00 0.00 H new ATOM 0 HD22 LEU A 67 41.701 44.614 27.321 1.00 0.00 H new ATOM 0 HD23 LEU A 67 41.371 46.044 28.327 1.00 0.00 H new ATOM 1079 N HIS A 68 46.259 46.288 28.978 1.00 0.00 N ATOM 1080 CA HIS A 68 47.683 46.420 29.212 1.00 0.00 C ATOM 1081 C HIS A 68 48.482 45.770 28.081 1.00 0.00 C ATOM 1082 O HIS A 68 48.168 44.661 27.653 1.00 0.00 O ATOM 1083 CB HIS A 68 48.058 45.869 30.584 1.00 0.00 C ATOM 1084 CG HIS A 68 47.556 46.714 31.722 1.00 0.00 C ATOM 1085 ND1 HIS A 68 48.359 47.422 32.615 1.00 0.00 N ATOM 1086 CD2 HIS A 68 46.244 46.885 32.081 1.00 0.00 C ATOM 1087 CE1 HIS A 68 47.527 48.033 33.461 1.00 0.00 C ATOM 1088 NE2 HIS A 68 46.251 47.727 33.176 1.00 0.00 N ATOM 0 H HIS A 68 45.893 45.361 29.194 1.00 0.00 H new ATOM 0 HA HIS A 68 47.942 47.479 29.214 1.00 0.00 H new ATOM 0 HB2 HIS A 68 47.657 44.861 30.685 1.00 0.00 H new ATOM 0 HB3 HIS A 68 49.143 45.789 30.651 1.00 0.00 H new ATOM 0 HD2 HIS A 68 45.379 46.449 31.604 1.00 0.00 H new ATOM 0 HE1 HIS A 68 47.837 48.684 34.265 1.00 0.00 H new ATOM 0 HE2 HIS A 68 45.429 48.059 33.681 1.00 0.00 H new ATOM 1096 N LEU A 69 49.512 46.462 27.603 1.00 0.00 N ATOM 1097 CA LEU A 69 50.363 46.070 26.498 1.00 0.00 C ATOM 1098 C LEU A 69 51.811 45.928 26.971 1.00 0.00 C ATOM 1099 O LEU A 69 52.453 46.897 27.369 1.00 0.00 O ATOM 1100 CB LEU A 69 50.199 47.084 25.368 1.00 0.00 C ATOM 1101 CG LEU A 69 51.179 46.964 24.205 1.00 0.00 C ATOM 1102 CD1 LEU A 69 51.155 45.608 23.505 1.00 0.00 C ATOM 1103 CD2 LEU A 69 50.859 48.031 23.161 1.00 0.00 C ATOM 0 H LEU A 69 49.785 47.360 28.002 1.00 0.00 H new ATOM 0 HA LEU A 69 50.071 45.093 26.113 1.00 0.00 H new ATOM 0 HB2 LEU A 69 49.187 46.996 24.973 1.00 0.00 H new ATOM 0 HB3 LEU A 69 50.290 48.085 25.790 1.00 0.00 H new ATOM 0 HG LEU A 69 52.171 47.091 24.639 1.00 0.00 H new ATOM 0 HD11 LEU A 69 51.880 45.606 22.691 1.00 0.00 H new ATOM 0 HD12 LEU A 69 51.409 44.825 24.220 1.00 0.00 H new ATOM 0 HD13 LEU A 69 50.159 45.423 23.104 1.00 0.00 H new ATOM 0 HD21 LEU A 69 51.558 47.947 22.329 1.00 0.00 H new ATOM 0 HD22 LEU A 69 49.842 47.889 22.796 1.00 0.00 H new ATOM 0 HD23 LEU A 69 50.948 49.019 23.612 1.00 0.00 H new ATOM 1115 N VAL A 70 52.334 44.709 26.879 1.00 0.00 N ATOM 1116 CA VAL A 70 53.714 44.349 27.139 1.00 0.00 C ATOM 1117 C VAL A 70 54.439 44.177 25.802 1.00 0.00 C ATOM 1118 O VAL A 70 53.939 43.506 24.902 1.00 0.00 O ATOM 1119 CB VAL A 70 53.763 43.107 28.022 1.00 0.00 C ATOM 1120 CG1 VAL A 70 55.186 42.621 28.285 1.00 0.00 C ATOM 1121 CG2 VAL A 70 53.117 43.366 29.381 1.00 0.00 C ATOM 0 H VAL A 70 51.770 43.904 26.605 1.00 0.00 H new ATOM 0 HA VAL A 70 54.231 45.136 27.688 1.00 0.00 H new ATOM 0 HB VAL A 70 53.216 42.344 27.468 1.00 0.00 H new ATOM 0 HG11 VAL A 70 55.156 41.735 28.919 1.00 0.00 H new ATOM 0 HG12 VAL A 70 55.667 42.374 27.338 1.00 0.00 H new ATOM 0 HG13 VAL A 70 55.752 43.406 28.786 1.00 0.00 H new ATOM 0 HG21 VAL A 70 53.168 42.461 29.987 1.00 0.00 H new ATOM 0 HG22 VAL A 70 53.647 44.172 29.888 1.00 0.00 H new ATOM 0 HG23 VAL A 70 52.074 43.650 29.240 1.00 0.00 H new